view article
Figure 5
Electron densities as calculated with VASP (full lines) and QE (dashed lines) along the z axis in the SbH4 crystal. Different DFAs are color coded: LDA in purple and PBE in green. Note that LDA and PBE lines overlap within the VASP calculation.

IUCrJ
Volume 12| Part 3| May 2025| Pages 295-306
ISSN: 2052-2525
https://doi.org/10.1107/S2052252525001721